4-[4-(8-methoxybenzo[b][1,4]benzoxazepin-6-yl)piperazin-1-yl]-2,2-dimethyl-N-methylsulfonyl-butanamide

Systemtic Name: 4-[4-(8-methoxybenzo[b][1,4]benzoxazepin-6-yl)piperazin-1-yl]-2,2-dimethyl-N-methylsulfonyl-butanamide Openeye Name: 4-[4-(8-methoxybenzo[b][1,4]benzoxazepin-6-yl)piperazin-1-yl]-2,2-dimethyl-N-methylsulfonyl-butanamide CAS Name: 4-[4-(8-methoxy-6-benzo[b][1,4]benzoxazepinyl)-1-piperazinyl]-2,2-dimethyl-N-methylsulfonylbutanamide IUPAC Name: 4-[4-(8-methoxybenzo[b][1,4]benzoxazepin-6-yl)piperazin-1-yl]-2,2-dimethyl-N-methylsulfonylbutanamide Traditional Name: N-mesyl-4-[4-(8-methoxybenzo[b][1,4]benzoxazepin-6-yl)piperazino]-2,2-dimethyl-butyramide Formula: C25H32N4O5S MolecularWeight: 500.61038

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCN1CCN(CC1)C2=NC3=CC=CC=C3OC4=C2C=C(C=C4)OC)C(=O)NS(=O)(=O)C

Isomeric SMILES

CC(C)(CCN1CCN(CC1)C2=NC3=CC=CC=C3OC4=C2C=C(C=C4)OC)C(=O)NS(=O)(=O)C

InChI

InChI=1S/C25H32N4O5S/c1-25(2,24(30)27-35(4,31)32)11-12-28-13-15-29(16-14-28)23-19-17-18(33-3)9-10-21(19)34-22-8-6-5-7-20(22)26-23/h5-10,17H,11-16H2,1-4H3,(H,27,30)